Benzene, 1,1'-(1-methylethylidene)bis[4-(4-nitrophenoxy)-
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Basic information
- CAS
20653-11-6- Standard SMILES
CC(C)(c1ccc(Oc2ccc([N+](=O)[O-])cc2)cc1)c1ccc(Oc2ccc([N+](=O)[O-])cc2)cc1- InChIKey
KQXREYWRKNCCOC-UHFFFAOYSA-N- Molecular formula
- C27H22N2O6
- Average molar mass
- 470.5 g/mol
- Monoisotopic mass
- 470.14778643
Names & identifiers
- Preferred name
- Benzene, 1,1'-(1-methylethylidene)bis[4-(4-nitrophenoxy)-
- IUPAC
- 1-(4-nitrophenoxy)-4-[2-[4-(4-nitrophenoxy)phenyl]propan-2-yl]benzene
- English name
- 1,1'-Isopropylidenebis(p-phenyleneoxy)bis(4-nitrobenzene)
- Molecular formula
- C27H22N2O6
- Molecular weight
- 470.47
Names & synonyms
Propane, 2,2-bis(p-(p-nitrophenoxy)phenyl)-2,2-Bis(p-(p-nitrophenoxy)phenyl)propane2,2-Bis[p-(p-nitrophenoxy)phenyl]propaneBenzene, 1,1'-(1-methylethylidene)bis(4-(4-nitrophenoxy)-Benzene, 1,1'-(1-methylethylidene)bis[4-(4-nitrophenoxy)-RefChem:56217220653-11-64,4'-(propane-2,2-diyl)bis((4-nitrophenoxy)benzene)1-(4-nitrophenoxy)-4-[2-[4-(4-nitrophenoxy)phenyl]propan-2-yl]benzene2,2-Bis[4-(4-nitrophenoxy)phenyl]propaneF0266-02581,1'-(Propane-2,2-diyl)bis[4-(4-nitrophenoxy)benzene]
Show more names
2,2'-Bis[4-(nitrophenoxy)phenyl]propane2,2'-Di-[4-(4-nitrophenoxy)phenyl]-propane2,2’-Di-[4-(4-nitrophenyloxy)phenyl]-propane2,2’-Di-[4-(4-nitrophenyloxy) phenyl]-propane1,1'-propane-2,2-diylbis[4-(4-nitrophenoxy)benzene]-Isopropylidenebis(p-phenyleneoxy)bis(4-nitrobenzene)
Oprea1_192433SCHEMBL9497275DTXSID2066640KQXREYWRKNCCOC-UHFFFAOYSA-NSMSSF-0041259STK270131AKOS0014836202,2-bis (4-(4-nitrophenoxy)phenyl)propane
Properties
Computed structural propertiesFilling in
- XLogP
- 7.4
- Topological polar surface area
- 110 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 6
- Heavy atoms
- 35
- Formal charge
- 0
- Complexity
- 629
Physicochemical properties
- Melting point
- 119 °C · 119 °C
- Boiling point
- 588.3 · 588.3±40.0 °C(Predicted)
- Density
- 1.279 · 1.279±0.06 g/cm3(Predicted)
- EPA Substance Registry System
- 2 · 2,2-Bis[p-(p-nitrophenoxy)phenyl]propane (20653-11-6)
- TSCA
- TSCA listed
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Hazard information
Regulatory InformationPMN - indicates a commenced PMN (Pre-Manufacture Notices) substance.
Safety data
- tsca
- TSCA listed
Chemistry & industry
Uses & manufacturing
General Manufacturing InformationBenzene, 1,1'-(1-methylethylidene)bis[4-(4-nitrophenoxy)-: INACTIVE
Upstream & downstream products
Downstream products
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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